| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 3rd, 2014 | 31 | No |
Popular Name: (E)-3-[4-[[6-(4-methoxyanilino)-7H-purin-2-yl]amino]-3,5-dimethyl-phenyl]prop-2-enenitrile (E)-3-[4-[[6-(4-methoxyanilino)-…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 6.38 | 13.78 | -14.99 | 3 | 8 | 0 | 112 | 411.469 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.